|
MWC01 |
molecular walk count of order 01 (number of non-H bonds, nBO) |
|
MWC02 |
molecular walk count of order 02 |
|
MWC03 |
molecular walk count of order 03 |
|
MWC04 |
molecular walk count of order 04 |
|
MWC05 |
molecular walk count of order 05 |
|
MWC06 |
molecular walk count of order 06 |
|
MWC07 |
molecular walk count of order 07 |
|
MWC08 |
molecular walk count of order 08 |
|
MWC09 |
molecular walk count of order 09 |
|
MWC10 |
molecular walk count of order 10 |
|
TWC |
total walk count |
|
SRW01 |
self-returning walk count of order 01 (number of non-H atoms, nSK) |
|
SRW02 |
self-returning walk count of order 02 (twice the number of non-H bonds) |
|
SRW03 |
self-returning walk count of order 03 |
|
SRW04 |
self-returning walk count of order 04 |
|
SRW05 |
self-returning walk count of order 05 |
|
SRW06 |
self-returning walk count of order 06 |
|
SRW07 |
self-returning walk count of order 07 |
|
SRW08 |
self-returning walk count of order 08 |
|
SRW09 |
self-returning walk count of order 09 |
|
SRW10 |
self-returning walk count of order 10 |
|
MPC01 |
molecular path count of order 01 (number of non-H bonds, nBO) |
|
MPC02 |
molecular path count of order 02 (Gordon-Scantlebury index) |
|
MPC03 |
molecular path count of order 03 |
|
MPC04 |
molecular path count of order 04 |
|
MPC05 |
molecular path count of order 05 |
|
MPC06 |
molecular path count of order 06 |
|
MPC07 |
molecular path count of order 07 |
|
MPC08 |
molecular path count of order 08 |
|
MPC09 |
molecular path count of order 09 |
|
MPC10 |
molecular path count of order 10 |
|
piPC01 |
molecular multiple path count of order 01 (sum of conventional bond orders, SCBO) |
|
piPC02 |
molecular multiple path count of order 02 |
|
piPC03 |
molecular multiple path count of order 03 |
|
piPC04 |
molecular multiple path count of order 04 |
|
piPC05 |
molecular multiple path count of order 05 |
|
piPC06 |
molecular multiple path count of order 06 |
|
piPC07 |
molecular multiple path count of order 07 |
|
piPC08 |
molecular multiple path count of order 08 |
|
piPC09 |
molecular multiple path count of order 09 |
|
piPC10 |
molecular multiple path count of order 10 |
|
TPC |
total path count |
|
piID |
conventional bond-order ID number |
|
PCR |
ratio of multiple path count over path count |
|
PCD |
difference between multiple path count and path count |
|
CID |
Randic ID number |
|
BID |
Balaban ID number |